4-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]cyclohexanecarboxamide CAS Name: 4-butyl-N-[3-(6-methylsulfonyl-3-pyridazinyl)phenyl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-[3-(6-mesylpyridazin-3-yl)phenyl]cyclohexanecarboxamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O3S/c1-3-4-6-16-9-11-17(12-10-16)22(26)23-19-8-5-7-18(15-19)20-13-14-21(25-24-20)29(2,27)28/h5,7-8,13-17H,3-4,6,9-12H2,1-2H3,(H,23,26)